Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY6 | Q15077 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SPHK1 | Q9NYA1 | 11/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | SPHK2 | Q9NRA0 | 7/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL10348276 | 1.00 | P2RY6 (0.47) | P2RY6MAOAMAOBMEN1MAPK1 | |
| SCHEMBL10347716 | 0.93 | SPHK1 (0.47) | P2RY6MEN1MAPK1KMT2ASPHK1 | |
| SCHEMBL10347715 | 0.93 | SPHK1 (0.47) | P2RY6MEN1MAPK1KMT2ASPHK1 | |
| SCHEMBL10477163 | 0.93 | SPHK1 (0.47) | P2RY6MEN1MAPK1KMT2ASPHK1 | |
| SCHEMBL10477108 | 0.93 | SPHK1 (0.47) | P2RY6MEN1MAPK1KMT2ASPHK1 | |
| SCHEMBL12286138 | 0.93 | P2RY6 (0.45) | P2RY6MEN1MAPK1KMT2ASPHK1 | |
| SCHEMBL10347666 | 0.92 | P2RY6 (0.47) | P2RY6MAOAMAOBMEN1MAPK1 | |
| SCHEMBL10347667 | 0.92 | P2RY6 (0.47) | P2RY6MAOAMAOBMEN1MAPK1 | |
| SCHEMBL10347641 | 0.91 | SPHK1 (0.52) | P2RY6MEN1MAPK1KMT2ASPHK1 | |
| SCHEMBL10347640 | 0.91 | SPHK1 (0.52) | P2RY6MEN1MAPK1KMT2ASPHK1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0227004-B1 | LIQUID CRYSTALLINE ETHANE DERIVATIVES, THEIR PREPARATION AND THE LIQUID CRYSTAL COMPOSITIONS CONTAINING SAME | Wojskowa Akademia Techniczna im. Jaroslawa Dabrowskiego (PL) | 1990-04-11 | — | — | EP | disclosed |
| US-4849130-A | ISOTHIOCYANATES | WOJSKOWA AKADEMIA TECHNICZNA (PL) | 1989-07-18 | — | — | US | disclosed |